9-[2-(2-carbazol-9-yl-6-methylphenyl)sulfanylphenyl]carbazole

C37H26N2S — CID 134228715

IUPAC9-[2-(2-carbazol-9-yl-6-methylphenyl)sulfanylphenyl]carbazole
SMILESCc1cccc(-n2c3ccccc3c3ccccc32)c1Sc1ccccc1-n1c2ccccc2c2ccccc21
InChIInChI=1S/C37H26N2S/c1-25-13-12-23-35(39-32-20-8-4-16-28(32)29-17-5-9-21-33(29)39)37(25)40-36-24-11-10-22-34(36)38-30-18-6-2-14-26(30)27-15-3-7-19-31(27)38/h2-24H,1H3
InChIKeyOXGYVZVGJMCHCE-UHFFFAOYSA-N
MW530.70 g/mol
LogP10.34
Rot. Bonds4

About 9-[2-(2-carbazol-9-yl-6-methylphenyl)sulfanylphenyl]carbazole

9-[2-(2-carbazol-9-yl-6-methylphenyl)sulfanylphenyl]carbazole (PubChem CID 134228715) has the molecular formula C37H26N2S and a molecular weight of 530.70 g/mol. Its IUPAC name is 9-[2-(2-carbazol-9-yl-6-methylphenyl)sulfanylphenyl]carbazole.

Molecular Properties

Compound Name9-[2-(2-carbazol-9-yl-6-methylphenyl)sulfanylphenyl]carbazole
PubChem CID134228715
Molecular FormulaC37H26N2S
Molecular Weight530.70 g/mol
Exact Mass530.18
IUPAC Name9-[2-(2-carbazol-9-yl-6-methylphenyl)sulfanylphenyl]carbazole
SMILESCc1cccc(-n2c3ccccc3c3ccccc32)c1Sc1ccccc1-n1c2ccccc2c2ccccc21
InChIInChI=1S/C37H26N2S/c1-25-13-12-23-35(39-32-20-8-4-16-28(32)29-17-5-9-21-33(29)39)37(25)40-36-24-11-10-22-34(36)38-30-18-6-2-14-26(30)27-15-3-7-19-31(27)38/h2-24H,1H3
InChIKeyOXGYVZVGJMCHCE-UHFFFAOYSA-N
XLogP10.34
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500530.70
LogP ≤ 510.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-carbazol-9-yl-9-(2-methylphenyl)carbazole
CID 174273239
9-[2-methyl-3-(2-methylphenyl)phenyl]carbazole
CID 67374081
4-(2-methylphenyl)thieno[3,4-b]indole
CID 132503643
3-carbazol-9-yl-9-[2-[2-(4-methylcarbazol-9-yl)phenyl]phenyl]carbazole
CID 170224676
3-carbazol-9-yl-9-[9-(2-carbazol-9-ylphenyl)carbazol-3-yl]carbazole
CID 167209844
3-methyl-9-[2-(3-methylcarbazol-9-yl)phenyl]carbazole
CID 58771355
3-(2-carbazol-9-ylphenyl)-9-(2-methylphenyl)carbazole
CID 164986167
9-(4-carbazol-9-ylnaphthalen-1-yl)carbazole
CID 154791880
9-(5-carbazol-9-yl-3,6-dimethyl-2-pyridinyl)carbazole
CID 170652172
9-[2-[6-[6-(5-carbazol-9-yl-2-methylphenyl)-2-pyridinyl]-2-pyridinyl]-3-methylphenyl]carbazole
CID 123748491
4-carbazol-9-yl-6-methylbenzimidazolo[1,2-a]benzimidazole
CID 164714389
[9-(2-methylphenyl)carbazol-3-yl]-triphenylsilane
CID 168811116

Frequently Asked Questions

What is the IUPAC name of 9-[2-(2-carbazol-9-yl-6-methylphenyl)sulfanylphenyl]carbazole?
The IUPAC name of 9-[2-(2-carbazol-9-yl-6-methylphenyl)sulfanylphenyl]carbazole (CID 134228715) is 9-[2-(2-carbazol-9-yl-6-methylphenyl)sulfanylphenyl]carbazole.
What is the SMILES notation for 9-[2-(2-carbazol-9-yl-6-methylphenyl)sulfanylphenyl]carbazole?
The canonical SMILES for 9-[2-(2-carbazol-9-yl-6-methylphenyl)sulfanylphenyl]carbazole is Cc1cccc(-n2c3ccccc3c3ccccc32)c1Sc1ccccc1-n1c2ccccc2c2ccccc21.
What is the InChIKey of 9-[2-(2-carbazol-9-yl-6-methylphenyl)sulfanylphenyl]carbazole?
The InChIKey is OXGYVZVGJMCHCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H26N2S/c1-25-13-12-23-35(39-32-20-8-4-16-28(32)29-17-5-9-21-33(29)39)37(25)40-36-24-11-10-22-34(36)38-30-18-6-2-14-26(30)27-15-3-7-19-31(27)38/h2-24H,1H3.
What are the key properties of 9-[2-(2-carbazol-9-yl-6-methylphenyl)sulfanylphenyl]carbazole?
9-[2-(2-carbazol-9-yl-6-methylphenyl)sulfanylphenyl]carbazole has a molecular weight of 530.70 g/mol, XLogP of 10.34, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2-(2-carbazol-9-yl-6-methylphenyl)sulfanylphenyl]carbazole is sourced from PubChem (CID 134228715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).